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Cas Database |
Name |
Acetamide,2-bromo-N-(2-nitrophenyl)- |
EINECS | N/A |
CAS No. | 5326-94-3 | Density | 1.755 g/cm3 |
PSA | 74.92000 | LogP | 2.52440 |
Solubility | N/A | Melting Point |
74 °C(Solv: ethanol (64-17-5)) |
Formula | C8H7BrN2O3 | Boiling Point | 431.1 °C at 760 mmHg |
Molecular Weight | 259.059 | Flash Point | 214.5 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure |
|
Hazard Symbols | N/A |
Synonyms |
2-Bromo-N-(2-nitrophenyl)acetamide;2-bromo-N-(2-nitrophenyl)acetamide; |
Article Data | 17 |
The Acetamide,2-bromo-N-(2-nitrophenyl)-, with the CAS registry number 5326-94-3, has the systematic name of 2-bromo-N-(2-nitrophenyl)acetamide. It should be stored in the dry and cool environment. And the molecular formula of this chemical is C8H7BrN2O3.
The physical properties of Acetamide,2-bromo-N-(2-nitrophenyl)- are as following: (1)ACD/LogP: 1.70; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 66.13 Å2; (7)Index of Refraction: 1.665; (8)Molar Refractivity: 54.8 cm3; (9)Molar Volume: 147.5 cm3; (10)Polarizability: 21.72×10-24cm3; (11)Surface Tension: 64.8 dyne/cm; (12)Density: 1.755 g/cm3; (13)Flash Point: 214.5 °C; (14)Enthalpy of Vaporization: 68.67 kJ/mol; (15)Boiling Point: 431.1 °C at 760 mmHg; (16)Vapour Pressure: 1.23E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc1ccccc1[N+]([O-])=O)CBr
(2)InChI: InChI=1/C8H7BrN2O3/c9-5-8(12)10-6-3-1-2-4-7(6)11(13)14/h1-4H,5H2,(H,10,12)
(3)InChIKey: MDQWPKGGEFPESZ-UHFFFAOYAW
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